N-[5-[(3-azanyl-4-nitro-phenyl)-[(3-oxidanylidene-3-phenyl-propanoyl)amino]amino]-2-nitro-phenyl]-N-cyano-ethanamide

Systemtic Name: N-[5-[(3-azanyl-4-nitro-phenyl)-[(3-oxidanylidene-3-phenyl-propanoyl)amino]amino]-2-nitro-phenyl]-N-cyano-ethanamide Openeye Name: N-[5-(3-amino-4-nitro-N-[(3-oxo-3-phenyl-propanoyl)amino]anilino)-2-nitro-phenyl]-N-cyano-acetamide CAS Name: N-[5-(3-amino-N-[(1,3-dioxo-3-phenylpropyl)amino]-4-nitroanilino)-2-nitrophenyl]-N-cyanoacetamide IUPAC Name: N-[5-(3-amino-4-nitro-N-[(3-oxo-3-phenylpropanoyl)amino]anilino)-2-nitrophenyl]-N-cyanoacetamide Traditional Name: N-[5-(3-amino-N-[(3-keto-3-phenyl-propanoyl)amino]-4-nitro-anilino)-2-nitro-phenyl]-N-cyano-acetamide Formula: C24H19N7O7 MolecularWeight: 517.45036

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C#N)C1=C(C=CC(=C1)N(C2=CC(=C(C=C2)[N+](=O)[O-])N)NC(=O)CC(=O)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)N(C#N)C1=C(C=CC(=C1)N(C2=CC(=C(C=C2)[N+](=O)[O-])N)NC(=O)CC(=O)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C24H19N7O7/c1-15(32)28(14-25)22-12-18(8-10-21(22)31(37)38)29(17-7-9-20(30(35)36)19(26)11-17)27-24(34)13-23(33)16-5-3-2-4-6-16/h2-12H,13,26H2,1H3,(H,27,34)